[(1R)-1-(2-nitrophenyl)ethyl]-[(2S)-pentan-2-yl]azanium

Systemtic Name: [(1R)-1-(2-nitrophenyl)ethyl]-[(2S)-pentan-2-yl]azanium Openeye Name: [(1S)-1-methylbutyl]-[(1R)-1-(2-nitrophenyl)ethyl]ammonium CAS Name: [(1R)-1-(2-nitrophenyl)ethyl]-[(2S)-pentan-2-yl]ammonium IUPAC Name: [(1R)-1-(2-nitrophenyl)ethyl]-[(2S)-pentan-2-yl]azanium Traditional Name: [(1S)-1-methylbutyl]-[(1R)-1-(2-nitrophenyl)ethyl]ammonium Formula: C13H21N2O2+ MolecularWeight: 237.31804

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)[NH2+]C(C)C1=CC=CC=C1[N+](=O)[O-]

Isomeric SMILES

CCC[C@H](C)[NH2+][C@H](C)C1=CC=CC=C1[N+](=O)[O-]

InChI

InChI=1S/C13H20N2O2/c1-4-7-10(2)14-11(3)12-8-5-6-9-13(12)15(16)17/h5-6,8-11,14H,4,7H2,1-3H3/p+1/t10-,11+/m0/s1